General Information of Drug (ID: DMMQHPB)

Drug Name
VTS-270
Synonyms ODLHGICHYURWBS-UHFFFAOYSA-N; AC1N9NUY; SCHEMBL19239855; 6A,6B,6C,6D,6E,6F,6G-Heptakis-O-(2-hydroxypropyl)-beta-cyclodextrin
Indication
Disease Entry ICD 11 Status REF
Niemann-pick disease 5C56.0Y Phase 3 [1]
Drug Type
Small molecular drug
Structure
3D MOL 2D MOL
Chemical Identifiers
Formula
C63H112O42
Canonical SMILES
CC(COCC1C2C(C(C(O1)OC3C(OC(C(C3O)O)OC4C(OC(C(C4O)O)OC5C(OC(C(C5O)O)OC6C(OC(C(C6O)O)OC7C(OC(C(C7O)O)OC8C(OC(O2)C(C8O)O)COCC(C)O)COCC(C)O)COCC(C)O)COCC(C)O)COCC(C)O)COCC(C)O)O)O)O
InChI
1S/C63H112O42/c1-22(64)8-85-15-29-50-36(71)43(78)57(92-29)100-51-30(16-86-9-23(2)65)94-59(45(80)38(51)73)102-53-32(18-88-11-25(4)67)96-61(47(82)40(53)75)104-55-34(20-90-13-27(6)69)98-63(49(84)42(55)77)105-56-35(21-91-14-28(7)70)97-62(48(83)41(56)76)103-54-33(19-89-12-26(5)68)95-60(46(81)39(54)74)101-52-31(17-87-10-24(3)66)93-58(99-50)44(79)37(52)72/h22-84H,8-21H2,1-7H3
InChIKey
ODLHGICHYURWBS-UHFFFAOYSA-N
Cross-matching ID
PubChem CID
4363642
CAS Number
128446-35-5
TTD ID
D01SNZ

References

1 ClinicalTrials.gov (NCT03643562) Niemann-Pick Type C Treatment With Adrabetadex for Symptoms of Brain and Nervous System. U.S. National Institutes of Health.